beta-Alanine, N-dodecyl-
TL;DR: beta-Alanine, N-dodecyl- (CAS 1462-54-0) is a chemical compound with molecular formula C15H31NO2 and molecular weight 257.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dodecylamino)propanoic acid
Also Known As: N-Dodecyl-beta-alanine, .beta.-Alanine, N-dodecyl-, 3-Dodecylaminopropionic acid, 3-(dodecylamino)propanoic acid, Dodecyl(carboxyethyl)amine
| Molecular Formula | C15H31NO2 |
|---|---|
| Molecular Weight | 257.24 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 14 |
| Exact Mass | 257.23547 |
| Heavy Atoms | 18 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 1462-54-0 |
|---|---|
| SMILES | CCCCCCCCCCCCNCCC(=O)O |
| InChIKey | AEDQNOLIADXSBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
beta-Alanine, N-dodecyl- (CAS 1462-54-0), with molecular formula C15H31NO2 and molecular weight 257.24 g/mol. IUPAC: 3-(dodecylamino)propanoic acid.
Chemical Property Profile of beta-Alanine, N-dodecyl-
Property Insights of beta-Alanine, N-dodecyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Alanine, N-dodecyl-. With a topological polar surface area (TPSA) of 49.3 Ų, beta-Alanine, N-dodecyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Alanine, N-dodecyl- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-Alanine, N-dodecyl-?
The CAS number of beta-Alanine, N-dodecyl- is 1462-54-0.
What is the molecular formula of beta-Alanine, N-dodecyl-?
The molecular formula of beta-Alanine, N-dodecyl- is C15H31NO2.
What is the molecular weight of beta-Alanine, N-dodecyl-?
The molecular weight of beta-Alanine, N-dodecyl- is 257.24 g/mol.
Where can I buy beta-Alanine, N-dodecyl-?
You can request a quote for beta-Alanine, N-dodecyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Alanine, N-dodecyl-?
Yes, KEHONG BIO provides custom synthesis services for beta-Alanine, N-dodecyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.